2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]ethanamide

Systemtic Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]ethanamide Openeye Name: 2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(4-hydroxy-3,5-dimethyl-phenyl)methyl]acetamide CAS Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-[(4-hydroxy-3,5-dimethylphenyl)methyl]acetamide IUPAC Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-hydroxy-3,5-dimethylphenyl)methyl]acetamide Traditional Name: 2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(4-hydroxy-3,5-dimethyl-benzyl)acetamide Formula: C20H22N4O2S2 MolecularWeight: 414.54428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)CNC(=O)CSC2=NN=C(N2C3CC3)C4=CC=CS4

Isomeric SMILES

CC1=CC(=CC(=C1O)C)CNC(=O)CSC2=NN=C(N2C3CC3)C4=CC=CS4

InChI

InChI=1S/C20H22N4O2S2/c1-12-8-14(9-13(2)18(12)26)10-21-17(25)11-28-20-23-22-19(16-4-3-7-27-16)24(20)15-5-6-15/h3-4,7-9,15,26H,5-6,10-11H2,1-2H3,(H,21,25)